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88648-40-2 | Phosphinic acid, (1-hydroxyethyl)-, 2-(4-methylphenyl)ethyl ester
CAS No: 88648-40-2 Catalog No: AG0049BW MDL No:
Product Description
Catalog Number:
AG0049BW
Chemical Name:
Phosphinic acid, (1-hydroxyethyl)-, 2-(4-methylphenyl)ethyl ester
CAS Number:
88648-40-2
Molecular Formula:
C11H17O3P
Molecular Weight:
228.2246
IUPAC Name:
1-hydroxyethyl-[2-(4-methylphenyl)ethoxy]-oxophosphanium
InChI:
InChI=1S/C11H16O3P/c1-9-3-5-11(6-4-9)7-8-14-15(13)10(2)12/h3-6,10,12H,7-8H2,1-2H3/q+1
InChI Key:
ZBQIJIRGWQJFBY-UHFFFAOYSA-N
SMILES:
O=P(C(O)C)OCCc1ccc(cc1)C
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.084g/mol
Formal Charge:
1
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.22g/mol
Monoisotopic Mass:
227.084g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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